Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2777155 | 0.92 | KCNJ1 (0.44) | RAB9AKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL13086654 | 0.81 | KCNJ1 (0.44) | RAB9AKDM4EALDH1A1SMN1; SMN2NPC1 | |
| Hydrochloric Acid SCHEMBL4256880 | 0.79 | RAB9A (0.55) | RAB9AKDM4EALDH1A1MAPTHIF1A | |
| Oxalic Acid SCHEMBL2780299 | 0.79 | PTGS2 (0.51) | RAB9AKDM4EALDH1A1MAPTSMN1; SMN2 | |
| Oxalic Acid SCHEMBL2780296 | 0.79 | PTGS2 (0.51) | RAB9AKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4252390 | 0.77 | CCR5 (0.55) | KDM4EALDH1A1MAPTSMN1; SMN2HPGD | |
| SCHEMBL13086333 | 0.75 | RAB9A (0.43) | RAB9AKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL4834964 | 0.74 | ALDH1A1 (0.66) | RAB9AKDM4EALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL23978208 | 0.74 | CTSB (0.53) | KDM4EALDH1A1MAPTSMN1; SMN2KCNJ1 | |
| Hydrochloric Acid SCHEMBL28030086 | 0.73 | CTSB (0.52) | KDM4EALDH1A1MAPTSMN1; SMN2KCNJ1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010118968-A1 | NO-DONOR ASPIRIN DERIVATIVES | NICOX S.A. (FR) | 2010-10-21 | — | — | WO | disclosed |